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Pimelic acid, 8-chlorooctyl octyl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, 8-chlorooctyl octyl ester
SpectraBase Compound ID 1hYLSx9DCUL
InChI InChI=1S/C23H43ClO4/c1-2-3-4-5-9-15-20-27-22(25)17-12-11-13-18-23(26)28-21-16-10-7-6-8-14-19-24/h2-21H2,1H3
InChIKey YDASLOCBJIOWNS-UHFFFAOYSA-N
Mol Weight 419.0 g/mol
Molecular Formula C23H43ClO4
Exact Mass 418.284988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LuwNDFfnLuc
Name Pimelic acid, 8-chlorooctyl octyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H43ClO4
InChI InChI=1S/C23H43ClO4/c1-2-3-4-5-9-15-20-27-22(25)17-12-11-13-18-23(26)28-21-16-10-7-6-8-14-19-24/h2-21H2,1H3
InChIKey YDASLOCBJIOWNS-UHFFFAOYSA-N
Molecular Weight 419.046 g/mol
SMILES C(CCCCCC(OCCCCCCCCCl)=O)(OCCCCCCCC)=O
SPLASH splash10-052f-9710000000-e1f281fc2695f77fa703
Source of Spectrum TIPS-2022-844-0
Wiley ID 1822361